SCHEMBL14979660

SCHEMBL14979660

COC[C@@H]1CN[C@H](C(=O)O)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 2/20 0.54
CYP1A2 P05177 3/20 0.48
ALOX15 P16050 3/20 0.48
CYP2C19 P33261 3/20 0.48
CYP2D6 P10635 3/20 0.48
SLC1A3 P43003 1/20 0.48
SLC1A2 P43004 1/20 0.48
SLC1A1 P43005 1/20 0.48
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
THRB P10828 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIA1 P42261 1/20 0.41
GRIA2 P42262 1/20 0.41
GRIA3 P42263 1/20 0.41
GRIA4 P48058 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17715175 1.00 ARG1 (0.54) ARG1CYP1A2ALOX15CYP2C19CYP2D6
SCHEMBL26116484 1.00 ARG1 (0.54) ARG1CYP1A2ALOX15CYP2C19CYP2D6
SCHEMBL25366838 1.00 ARG1 (0.54) ARG1CYP1A2ALOX15CYP2C19CYP2D6
SCHEMBL6122490 1.00 ARG1 (0.54) ARG1CYP1A2ALOX15CYP2C19CYP2D6
Hydrochloric Acid SCHEMBL26117849 0.98 ARG1 (0.53) ARG1CYP1A2ALOX15CYP2C19CYP2D6
Hydrochloric Acid SCHEMBL25361652 0.98 ARG1 (0.53) ARG1CYP1A2ALOX15CYP2C19CYP2D6
Hydrochloric Acid SCHEMBL25362592 0.98 ARG1 (0.53) ARG1CYP1A2ALOX15CYP2C19CYP2D6
Hydrochloric Acid SCHEMBL29035430 0.98 ARG1 (0.53) ARG1CYP1A2ALOX15CYP2C19CYP2D6
SCHEMBL22399152 0.85 ARG1 (0.39) ARG1CYP1A2ALOX15CYP2C19CYP2D6
SCHEMBL14979674 0.83 CHRNB2 (0.39) ARG1CYP1A2ALOX15CYP2C19CYP2D6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9902693-B2 Preparation method for pyrrolidine-2-carboxylic acid derivatives ZHEJIANG JIUZHOU PHARMACEUTICAL CO., LTD. (CN) 2018-02-27 US disclosed
US-20170342085-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. 2017-11-30 US disclosed
US-9809600-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2017-11-07 US disclosed
EP-3239153-A1 9-(1H-IMIDAZOL-5-YL)-1,11-DIHYDROISOCHROMENO[4',3':6,7]NAPHTHO[1,2-D]IMIDAZOLE DERIVATIVES AND THEIR USE AS INHIBITORS OF HCV NS5A Gilead Pharmasset LLC (US) 2017-11-01 EP disclosed
EP-3239152-A1 ANTIVIRAL COMPOUNDS Gilead Sciences, Inc. (US) 2017-11-01 EP disclosed
US-9682989-B2 Antiviral compounds GILEAD PHARMASSET LLC (US) 2017-06-20 US disclosed
EP-2640719-B1 ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC (US) 2017-05-10 EP disclosed
EP-2935279-B1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES INC (US) 2017-03-15 EP disclosed
EP-2850085-B1 ANTIVIRAL COMPOUNDS INHIBITORS OF HCV NS5A GILEAD PHARMASSET LLC (US) 2017-03-15 EP disclosed
EP-2907816-A1 Condensed imidazolylimidazoles as antiviral compounds Gilead Pharmasset LLC (US) 2015-08-19 EP disclosed
EP-2635588-B1 CONDENSED IMIDAZOLYLIMIDAZOLES AS ANTIVIRAL COMPOUNDS GILEAD PHARMASSET LLC (US) 2015-06-10 EP disclosed
WO-2014100500-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2014-06-26 WO disclosed
US-20130177530-A1 ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2013-07-11 US disclosed
WO-2013075029-A1 CONDENSED IMIDAZOLYLIMIDAZOLES AS ANTIVIRAL COMPOUNDS GILEAD SCIENCES, INC. (US) 2013-05-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130177530-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 ARG1 3035/4885CYP1A2 4323/4885ALOX15 2615/4885
US-20170342085-A1 ANTIVIRAL COMPOUNDS MAVS, EIF2AK2, SARS1 ARG1 3035/4885CYP1A2 4323/4885ALOX15 2615/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.